[2-[[2-(cyclopentylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-ethyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[[2-(cyclopentylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-ethyl-(thiophen-2-ylmethyl)azanium Openeye Name: [2-[2-(cyclopentylcarbamoyl)anilino]-2-oxo-ethyl]-ethyl-(2-thienylmethyl)ammonium CAS Name: [2-[2-[(cyclopentylamino)-oxomethyl]anilino]-2-oxoethyl]-ethyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]-ethyl-(thiophen-2-ylmethyl)azanium Traditional Name: [2-[2-(cyclopentylcarbamoyl)anilino]-2-keto-ethyl]-ethyl-(2-thenyl)ammonium Formula: C21H28N3O2S+ MolecularWeight: 386.53092

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CS1)CC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3

Isomeric SMILES

CC[NH+](CC1=CC=CS1)CC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3

InChI

InChI=1S/C21H27N3O2S/c1-2-24(14-17-10-7-13-27-17)15-20(25)23-19-12-6-5-11-18(19)21(26)22-16-8-3-4-9-16/h5-7,10-13,16H,2-4,8-9,14-15H2,1H3,(H,22,26)(H,23,25)/p+1